propyl 5-ethanoyl-2-oxidanyl-benzoate

Systemtic Name: propyl 5-ethanoyl-2-oxidanyl-benzoate Openeye Name: propyl 5-acetyl-2-hydroxy-benzoate CAS Name: 5-acetyl-2-hydroxybenzoic acid propyl ester IUPAC Name: propyl 5-acetyl-2-hydroxybenzoate Traditional Name: 5-acetyl-2-hydroxy-benzoic acid propyl ester Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=CC(=C1)C(=O)C)O

Isomeric SMILES

CCCOC(=O)C1=C(C=CC(=C1)C(=O)C)O

InChI

InChI=1S/C12H14O4/c1-3-6-16-12(15)10-7-9(8(2)13)4-5-11(10)14/h4-5,7,14H,3,6H2,1-2H3